Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | GPR6 | P46095 | 1/20 | 0.47 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CCR6 | P51684 | 1/20 | 0.40 |
| ▸ | GBA1 | P04062 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5742813 | 0.90 | CCR6 (0.46) | L3MBTL1LMNAALDH1A1GAARAB9A | |
| SCHEMBL5741867 | 0.87 | LMNA (0.51) | L3MBTL1LMNAALDH1A1GAANPSR1 | |
| SCHEMBL5741940 | 0.86 | LMNA (0.50) | L3MBTL1LMNAALDH1A1GAANPSR1 | |
| SCHEMBL5740010 | 0.81 | MEN1 (0.47) | LMNAALDH1A1GAANPSR1MAPT | |
| SCHEMBL3823767 | 0.80 | GPR6 (0.47) | L3MBTL1LMNAALDH1A1GAAGPR6 | |
| SCHEMBL5742311 | 0.79 | MEN1 (0.52) | L3MBTL1LMNAALDH1A1GAANPSR1 | |
| SCHEMBL5741293 | 0.79 | MEN1 (0.42) | LMNAALDH1A1GAANPSR1MAPT | |
| SCHEMBL5741317 | 0.78 | KMT2A (0.53) | LMNAALDH1A1GAANPSR1PAX8 | |
| SCHEMBL5739813 | 0.78 | ALDH1A1 (0.43) | LMNAALDH1A1GAANPSR1MAPT | |
| SCHEMBL5740080 | 0.78 | MEN1 (0.51) | L3MBTL1LMNAALDH1A1GAANPSR1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1646615-A1 | PYRIMIDINE DERIVATIVES AS MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | Vertex Pharmaceuticals Incorporated (US) | 2006-04-19 | — | — | EP | disclosed |
| WO-2004111014-A1 | PYRIMIDINE DERIVATIVES AS MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2004-12-23 | — | — | WO | disclosed |